Crystallography Open Database

Information card for entry 4000612

Preview

Coordinates	4000612.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ba7 Se13 Sn3
Calculated formula	Ba7 Se13 Sn3
SMILES	[Ba+2].[Se-][Sn]([Se-])([Se-])[Se-].[Ba+2].[Se-][Sn]([Se-])([Se-])[Se-].[Ba+2].[Ba+2].[Se-2].[Ba+2].[Se-][Sn]([Se-])([Se-])[Se-].[Ba+2].[Ba+2]
Journal of publication	Chemistry of Materials
Year of publication	2005
a	12.7484 ± 0.0014 Å
b	24.891 ± 0.003 Å
c	9.2115 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	2923 ± 0.5 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	3
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Version history is temporarily not available due to server issues.